Publications


2018


Sega, M, Hantal, G, Fabian, B & Jedlovszky, P 2018, 'Pytim: A Python Package for the Interfacial Analysis of Molecular Simulations', Journal of Computational Chemistry, vol. 39, no. 25, pp. 2118-2125. https://doi.org/10.1002/jcc.25384

Mair, A, Tung, C, Cacciuto, A & Coluzza, I 2018, 'Translocation of a globular polymer through a hairy pore', Journal of Molecular Liquids, vol. 265, pp. 603-610. https://doi.org/10.1016/j.molliq.2018.06.009

Burian, M, Karner, C, Yarema, M, Heiss, W, Amenitsch, H, Dellago, C & Lechner, RT 2018, 'A Shape-Induced Orientation Phase within 3D Nanocrystal Solids', Advanced Materials, vol. 30, no. 32, 1802078. https://doi.org/10.1002/adma.201802078

Ivanov, AO, Kantorovich, SS, Zverev, VS, Lebedev, AV, Pshenichnikov, AF & Camp, PJ 2018, 'Concentration-dependent zero-field magnetic dynamic response of polydisperse ferrofluids', Journal of Magnetism and Magnetic Materials, vol. 459, no. SI, pp. 252-255. https://doi.org/10.1016/j.jmmm.2017.10.089

Tubiana, L, Jurasek, M & Coluzza, I 2018, 'Implementing efficient concerted rotations using Mathematica and C code', European Physical Journal E, vol. 41, no. 7, 87. https://doi.org/10.1140/epje/i2018-11694-7

Sega, M, Horvai, G & Jedlovszky, P 2018, 'On the calculation of the surface entropy in computer simulation', Journal of Molecular Liquids, vol. 262, pp. 58-62. https://doi.org/10.1016/j.molliq.2018.04.004

Sega, M & Jedlovszky, P 2018, 'The impact of tensorial temperature on equilibrium thermodynamics', Physical Chemistry Chemical Physics, vol. 20, no. 25, pp. 16910-16912. https://doi.org/10.1039/c8cp02046a

Cardelli, C, Barducci, A & Procacci, P 2018, 'Lipid tempering simulation of model biological membranes on parallel platforms', Biochimica et Biophysica Acta - Biomembranes, vol. 1860, no. 7, pp. 1480-1488. https://doi.org/10.1016/j.bbamem.2018.04.013

Karner, C, Artacho, A & Cardelli, C 2018, Embodied simulations of physical phenomena. in Proceedings of the 5th International Conference on Movement and Computing, MOCO 2018., a54, Association for Computing Machinery, Inc, ACM International Conference Proceeding Series (ICPS), 5th International Conference on Movement and Computing, MOCO 2018, Genoa, Italy, 28/06/18. https://doi.org/10.1145/3212721.3212894

Singraber, A, Morawietz, T, Behler, J & Dellago, C 2018, 'Density anomaly of water at negative pressures from first principles', Journal of Physics: Condensed Matter, vol. 30, no. 25, 254005. https://doi.org/10.1088/1361-648X/aac4f4

Wirnsberger, P, Dellago, C, Frenkel, D & Reinhardt, A 2018, 'Theoretical Prediction of Thermal Polarization', Physical Review Letters, vol. 120, no. 22, 226001. https://doi.org/10.1103/PhysRevLett.120.226001

Weiss, L, Dahirel, V, Marry, V & Jardat, M 2018, 'Computation of the Hydrodynamic Radius of Charged Nanoparticles from Nonequilibrium Molecular Dynamics', The Journal of Physical Chemistry Part B: Condensed Matter, Materials, Surfaces, Interfaces & Biophysical, vol. 122, no. 22, pp. 5940-5950. https://doi.org/10.1021/acs.jpcb.8b01153

Colla, T, Mohanty, PS, Nöjd, S, Bialik, E, Riede, A, Schurtenberger, P & Likos, CN 2018, 'Self-Assembly of Ionic Microgels Driven by an Alternating Electric Field: Theory, Simulations, and Experiments', ACS Nano, vol. 12, no. 5, pp. 4321-4337. https://doi.org/10.1021/acsnano.7b08843

Doukas, A-K, Likos, CN & Ziherl, P 2018, 'Structure formation in soft nanocolloids: liquid-drop model', Soft Matter, vol. 14, no. 16, pp. 3063-3072. https://doi.org/10.1039/c8sm00293b